Vitas-M small molecule compound
ethyl 6'-amino-1-ethyl-3'-methyl-5-nitro-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Catalog ID
STK980392
SMILES CCOC(=O)C1=C(N)Oc2c(C31C(=O)N(c1c3cc(cc1)[N+](=O)[O-])CC)c(C)nn2c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H23N5O6 MW 489.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O6/c1-4-28-18-12-11-16(30(33)34)13-17(18)25(24(28)32)19-14(3)27-29(15-9-7-6-8-10-15)22(19)36-21(26)20(25)23(31)35-5-2/h6-13H,4-5,26H2,1-3H3InChIKey
UHMPOHIWHUEGNS-UHFFFAOYSA-NSynonyms
CCN1C2=C(C=C(C=C2)(N+)(=O)(O))C3(C1=O)C4=C(N(N=C4C)C5=CC=CC=C5)OC(=C3C(=O)OCC)N
CCOC(=O)C1=C(N)Oc2c(C31C(=O)N(c1c3cc(cc1)(N+)(=O)(O))CC)c(C)nn2c1ccccc1
ethyl6amino1ethyl3methyl5nitro2oxo1phenyl12dihydro1Hspiro(indole34pyrano(23c)pyrazole)5carboxylate
ETHYL6AMINO1ETHYL3METHYL5NITRO2OXO1PHENYLSPIRO(INDOLE34PYRANO(23C)PYRAZOLE)5CARBOXYLATE
InChI=1SC25H23N5O6c142818121116(30(33)34)1317(18)25(24(28)32)1914(3)2729(1597681015)22(19)3621(26)20(25)23(31)3552h613H4526H213H3
MFCD06622755
ZINC000015016989
ZINC000015016990
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